tert-butyl 4-[(7-chloranylisoquinolin-6-yl)amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(7-chloranylisoquinolin-6-yl)amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(7-chloro-6-isoquinolyl)amino]piperidine-1-carboxylate CAS Name: 4-[(7-chloro-6-isoquinolinyl)amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(7-chloroisoquinolin-6-yl)amino]piperidine-1-carboxylate Traditional Name: 4-[(7-chloro-6-isoquinolyl)amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H24ClN3O2 MolecularWeight: 361.86576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)NC2=C(C=C3C=NC=CC3=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)NC2=C(C=C3C=NC=CC3=C2)Cl

InChI

InChI=1S/C19H24ClN3O2/c1-19(2,3)25-18(24)23-8-5-15(6-9-23)22-17-11-13-4-7-21-12-14(13)10-16(17)20/h4,7,10-12,15,22H,5-6,8-9H2,1-3H3